6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

C19H17F3N4O2 — CID 167019079

IUPAC6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESC=C(F)CCc1cn2cc(NC(=O)c3cccc(C(F)F)n3)cc(OC)c2n1
InChIInChI=1S/C19H17F3N4O2/c1-11(20)6-7-12-9-26-10-13(8-16(28-2)18(26)23-12)24-19(27)15-5-3-4-14(25-15)17(21)22/h3-5,8-10,17H,1,6-7H2,2H3,(H,24,27)
InChIKeyUAZFTGIUWLDJAK-UHFFFAOYSA-N
MW390.37 g/mol
LogP4.34
Rot. Bonds7

About 6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (PubChem CID 167019079) has the molecular formula C19H17F3N4O2 and a molecular weight of 390.37 g/mol. Its IUPAC name is 6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
PubChem CID167019079
Molecular FormulaC19H17F3N4O2
Molecular Weight390.37 g/mol
Exact Mass390.13
IUPAC Name6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESC=C(F)CCc1cn2cc(NC(=O)c3cccc(C(F)F)n3)cc(OC)c2n1
InChIInChI=1S/C19H17F3N4O2/c1-11(20)6-7-12-9-26-10-13(8-16(28-2)18(26)23-12)24-19(27)15-5-3-4-14(25-15)17(21)22/h3-5,8-10,17H,1,6-7H2,2H3,(H,24,27)
InChIKeyUAZFTGIUWLDJAK-UHFFFAOYSA-N
XLogP4.34
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.37
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The IUPAC name of 6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (CID 167019079) is 6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is C=C(F)CCc1cn2cc(NC(=O)c3cccc(C(F)F)n3)cc(OC)c2n1.
What is the InChIKey of 6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The InChIKey is UAZFTGIUWLDJAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F3N4O2/c1-11(20)6-7-12-9-26-10-13(8-16(28-2)18(26)23-12)24-19(27)15-5-3-4-14(25-15)17(21)22/h3-5,8-10,17H,1,6-7H2,2H3,(H,24,27).
What are the key properties of 6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide has a molecular weight of 390.37 g/mol, XLogP of 4.34, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-N-[2-(3-fluorobut-3-enyl)-8-methoxyimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is sourced from PubChem (CID 167019079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).